Molecular dynamics in the organic solid state - x-ray crystallography and nmr investigations of the molecular disorder in inclusion compounds
4РП — Обучение и мобилност на изследователи
- Период
- 1998-03-01 → 2000-02-29
- Финансиране от ЕС
- —
- Участници
- 2
- Схема
- RGI
Линиите свързват координатора с партньорите. За проекти отпреди 2014 г. CORDIS не винаги дава точни координати. Тези точки са на ниво град или държава.
Накратко на български
Молекулните движения на гостуващи частици в кристални структури се анализират чрез рентгенови лъчи и ядренен магнитен резонанс. Разбирането на този хаос помага при създаването на материали с определени физически свойства.
Кратко обяснение, генерирано от езиков модел по текста на CORDIS. Оригиналът е по-долу.
Цел на проекта
Research objectives and content Comprehension of molecular dynamics and disorder is a complicated and subtle topic but of great interest for solid state chemistry, and particularly design of materials with specific physical properties. This project aims the characterization of the molecular motions of guest molecules intercalated in various inclusion compounds. The methodology based on a combination of modern solid state NMR studies and X-Ray diffraction experiments, developed in the Inorganic Chemistry Laboratory of Oxford, will be improved and adapted for the specific case of intercalation compounds. Several host lattices will be tested in order to examine the influence of the inclusion environment upon the internal dynamics of the host molecule. Experimental results will be interpreted with assistance of mechanical and molecular dynamics calculations. The new synthetised inclusion materials will be the subject of a complete X-Ray characterization, including possible order-disorder structural phase transitions studies. Training content (objective, benefit and expected impact) I will gained during this international experience a scientific knowledge concerning modern solid state NMR approach of disorder and dynamical processes. The host institution will benefit of my experiences in computational chemistry and in crystallographic characterization of phase transitions acquired during my thesis work. This project will be a good international experience, in regard to the reputation of the host laboratory, and a launching advisability for a future research career in the field of molecular solid state chemistry. Links with industry / industrial relevance (22)
Оригинален текст от CORDIS (на английски).
Участници
- THE CHANCELLOR, MASTERS AND SCHOLARS OF THE UNIVERSITY OF OXFORD · OXFORDКоординаторОбединеното кралство
- Not availableНиво градФранция
Връзки
Данни: CORDIS, © Европейски съюз